2-(N-Boc-amino)thiophene - CAS 56267-50-6
Catalog: |
BB029313 |
Product Name: |
2-(N-Boc-amino)thiophene |
CAS: |
56267-50-6 |
Synonyms: |
N-thiophen-2-ylcarbamic acid tert-butyl ester; tert-butyl N-thiophen-2-ylcarbamate |
IUPAC Name: | tert-butyl N-thiophen-2-ylcarbamate |
Description: | 2-(N-Boc-amino)thiophene (CAS# 56267-50-6) is a useful research chemical. |
Molecular Weight: | 199.27 |
Molecular Formula: | C9H13NO2S |
Canonical SMILES: | CC(C)(C)OC(=O)NC1=CC=CS1 |
InChI: | InChI=1S/C9H13NO2S/c1-9(2,3)12-8(11)10-7-5-4-6-13-7/h4-6H,1-3H3,(H,10,11) |
InChI Key: | QTXXTRMGTVEBIN-UHFFFAOYSA-N |
Boiling Point: | 238.1 °C at 760 mmHg |
Density: | 1.186 g/cm3 |
Appearance: | Solid |
MDL: | MFCD02677742 |
LogP: | 3.16810 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-2021055604-A1 | Polarizer and image display device | 20180330 |
CN-108640919-A | The matrine derivative and Sophoridine derivative and preparation method thereof of amidine containing aryl or aminoquinoline structure | 20180320 |
CN-108640919-B | Matrine derivative and sophoridine derivative containing aryl amidine or aminoquinoline structure and preparation method thereof | 20180320 |
EP-3568390-A1 | Small molecule activators of nicotinamide phosphoribosyltransferase (nampt) and uses thereof | 20170110 |
WO-2018132372-A1 | Small molecule activators of nicotinamide phosphoribosyltransferase (nampt) and uses thereof | 20170110 |
Complexity: | 189 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 199.06669983 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 199.06669983 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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Amines and Anilines
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